RDKit 3D 47 50 0 0 0 0 0 0 0 0999 V2000 -5.4393 -1.4665 0.9734 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2116 -1.8679 -0.4781 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8020 -2.3941 -0.7492 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7580 -1.3477 -0.5999 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4599 -0.1862 -1.2725 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3317 0.3251 -0.5952 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9524 -0.4829 0.4041 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8571 -1.5292 0.4022 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 1.5698 -0.8668 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1524 2.8130 -0.2211 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4998 2.8790 1.1469 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9416 2.5255 0.8511 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8579 1.4922 -0.2428 N 0 0 0 0 0 4 0 0 0 0 0 0 1.9812 1.5070 -1.2329 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3124 1.2788 -0.6199 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2397 2.2530 -0.2938 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3136 1.6072 0.2433 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1416 0.2864 0.3177 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9434 0.0596 -0.2323 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4140 -1.4244 -0.3561 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1317 -2.5113 0.1026 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4494 -3.7442 -0.1125 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2380 -3.5568 -0.7377 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9337 -1.9060 -1.0508 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.2614 -2.3112 1.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7837 -0.6424 1.2694 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4745 -1.1354 1.1085 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4300 -1.0103 -1.1263 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9326 -2.6528 -0.7362 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5877 -3.2420 -0.0874 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7607 -2.7794 -1.7744 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9894 0.2203 -2.1232 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4278 1.7100 -1.9487 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8768 3.7021 -0.8012 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2445 2.7829 -0.1548 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5953 3.8683 1.6046 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9484 2.1470 1.8274 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4696 2.0920 1.7049 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4818 3.3945 0.4609 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8758 0.5649 0.2204 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7600 0.7590 -1.9995 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9466 2.4860 -1.7284 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2442 3.3282 -0.4047 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1884 2.0008 0.5836 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1032 -2.4288 0.5769 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8309 -4.7178 0.1743 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5195 -4.3151 -1.0208 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 7 8 1 0 6 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 23 24 1 0 8 4 1 0 13 9 1 0 19 15 1 0 24 20 1 0 1 25 1 0 1 26 1 0 1 27 1 0 2 28 1 0 2 29 1 0 3 30 1 0 3 31 1 0 5 32 1 0 9 33 1 6 10 34 1 0 10 35 1 0 11 36 1 0 11 37 1 0 12 38 1 0 12 39 1 0 13 40 1 0 14 41 1 0 14 42 1 0 16 43 1 0 17 44 1 0 21 45 1 0 22 46 1 0 23 47 1 0 M CHG 1 13 1 M END